propyl 2-[(2S)-1-[2-(3-methylbutoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: propyl 2-[(2S)-1-[2-(3-methylbutoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: propyl 2-[(2S)-1-(2-isopentyloxybenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[(2S)-1-[[2-(3-methylbutoxy)phenyl]-oxomethyl]-3-oxo-2-piperazinyl]acetic acid propyl ester IUPAC Name: propyl 2-[(2S)-1-[2-(3-methylbutoxy)benzoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[(2S)-1-(2-isoamoxybenzoyl)-3-keto-piperazin-2-yl]acetic acid propyl ester Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=CC=C2OCCC(C)C

Isomeric SMILES

CCCOC(=O)C[C@H]1C(=O)NCCN1C(=O)C2=CC=CC=C2OCCC(C)C

InChI

InChI=1S/C21H30N2O5/c1-4-12-28-19(24)14-17-20(25)22-10-11-23(17)21(26)16-7-5-6-8-18(16)27-13-9-15(2)3/h5-8,15,17H,4,9-14H2,1-3H3,(H,22,25)/t17-/m0/s1